N-[1-(2-methoxyethyl)-4,5-dimethyl-3-(4-methylphenyl)sulfonyl-pyrrol-2-yl]pyridine-4-carboxamide

Systemtic Name: N-[1-(2-methoxyethyl)-4,5-dimethyl-3-(4-methylphenyl)sulfonyl-pyrrol-2-yl]pyridine-4-carboxamide Openeye Name: N-[1-(2-methoxyethyl)-4,5-dimethyl-3-(p-tolylsulfonyl)pyrrol-2-yl]pyridine-4-carboxamide CAS Name: N-[1-(2-methoxyethyl)-4,5-dimethyl-3-(4-methylphenyl)sulfonyl-2-pyrrolyl]-4-pyridinecarboxamide IUPAC Name: N-[1-(2-methoxyethyl)-4,5-dimethyl-3-(4-methylphenyl)sulfonylpyrrol-2-yl]pyridine-4-carboxamide Traditional Name: N-[1-(2-methoxyethyl)-4,5-dimethyl-3-tosyl-pyrrol-2-yl]isonicotinamide Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C(=C2C)C)CCOC)NC(=O)C3=CC=NC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C(=C2C)C)CCOC)NC(=O)C3=CC=NC=C3

InChI

InChI=1S/C22H25N3O4S/c1-15-5-7-19(8-6-15)30(27,28)20-16(2)17(3)25(13-14-29-4)21(20)24-22(26)18-9-11-23-12-10-18/h5-12H,13-14H2,1-4H3,(H,24,26)